In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 10th, 2010 | 11 | No |
Popular Name: 4-pentylthiomorpholine 4-pentylthiomorpholine
None
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.67 | 7.41 | -35.8 | 1 | 1 | 1 | 4 | 174.333 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.67 | 5.31 | -1.74 | 0 | 1 | 0 | 3 | 173.325 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0450066A1; EP0450066B1; US5227381; US5401740 | IBM Patent Data |